RefChem:215742
TL;DR: RefChem:215742 (CAS 61377-19-3) is a chemical compound with molecular formula C32H40O4 and molecular weight 488.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-bis(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)cyclobutane-1,2-dione
Also Known As: 3,4-Bis cyclobutane-1,2-dione, 1,2-Cyclobutanedione, 3,4-bis[3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene]-, 3,4-bis(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)cyclobutane-1,2-dione, 3,4-Bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene)-1,2-cyclobutanedione, 1,2-Cyclobutanedione, 3,4-bis(3,5-bis(1,1-dimethylethyl)-4-oxo-2,5-cyclohexadien-1-ylidene)-
| Molecular Formula | C32H40O4 |
|---|---|
| Molecular Weight | 488.29 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 488.29266 |
| Heavy Atoms | 36 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 61377-19-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C2C(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)C(=O)C2=O)C=C(C1=O)C(C)(C)C |
| InChIKey | AZGREPHORDYXEK-UHFFFAOYSA-N |
Product Overview
RefChem:215742 (CAS 61377-19-3), with molecular formula C32H40O4 and molecular weight 488.29 g/mol. IUPAC: 3,4-bis(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)cyclobutane-1,2-dione.
Chemical Property Profile of RefChem:215742
Property Insights of RefChem:215742
The XLogP value of 7.2 indicates that RefChem:215742 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:215742. Following Lipinski's Rule of Five, RefChem:215742 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:215742?
The CAS number of RefChem:215742 is 61377-19-3.
What is the molecular formula of RefChem:215742?
The molecular formula of RefChem:215742 is C32H40O4.
What is the molecular weight of RefChem:215742?
The molecular weight of RefChem:215742 is 488.29 g/mol.
Where can I buy RefChem:215742?
You can request a quote for RefChem:215742 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:215742?
Yes, KEHONG BIO provides custom synthesis services for RefChem:215742 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.